IDI1_021090
TL;DR: IDI1_021090 (CAS 438461-73-5) is a chemical compound with molecular formula C16H17NO3S2 and molecular weight 335.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(4-methoxyphenyl)methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: IDI1_021090, BRD-A30068571-001-01-5, (5Z)-5-(4-methoxybenzylidene)-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one, (Z)-5-(4-methoxybenzylidene)-3-((tetrahydrofuran-2-yl)methyl)-2-thioxothiazolidin-4-one, (5Z)-5-[(4-methoxyphenyl)methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C16H17NO3S2 |
|---|---|
| Molecular Weight | 335.06 g/mol |
| LogP | 3.0754 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.06497 |
| Heavy Atoms | 22 |
| Complexity | 606.32184 |
Chemical Identifiers
| CAS Number | 438461-73-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CC3CCCO3 |
Product Overview
IDI1_021090 (CAS 438461-73-5), with molecular formula C16H17NO3S2 and molecular weight 335.06 g/mol. IUPAC: (5Z)-5-[(4-methoxyphenyl)methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of IDI1_021090
Property Insights of IDI1_021090
The XLogP value of 3.0754 indicates that IDI1_021090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, IDI1_021090 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, IDI1_021090 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of IDI1_021090?
The CAS number of IDI1_021090 is 438461-73-5.
What is the molecular formula of IDI1_021090?
The molecular formula of IDI1_021090 is C16H17NO3S2.
What is the molecular weight of IDI1_021090?
The molecular weight of IDI1_021090 is 335.06 g/mol.
Where can I buy IDI1_021090?
You can request a quote for IDI1_021090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IDI1_021090?
Yes, KEHONG BIO provides custom synthesis services for IDI1_021090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.